Reliability of HF/IQA, B3LYP/IQA, and MP2/IQA data in interpreting the nature and strength of interactions

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Authors

Cukrowski, Ignacy

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Royal Society of Chemistry

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Keywords

Interacting quantum atoms (IQA), HF, B3LYP, MP2, Fragment attributed molecular system energy change (FAMSEC), AIMAll, Interactions

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Cukrowski, I. 2019, 'Reliability of HF/IQA, B3LYP/IQA, and MP2/IQA data in interpreting the nature and strength of interactions', Physical Chemistry Chemical Physics, vol. 21, no. 20, pp.10244-10260.